N-[(E)-[(5S)-5-methylheptan-3-ylidene]amino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-[(5S)-5-methylheptan-3-ylidene]amino]-2,4-dinitro-aniline Openeye Name: N-[(E)-[(3S)-1-ethyl-3-methyl-pentylidene]amino]-2,4-dinitro-aniline CAS Name: N-[(E)-[(5S)-5-methylheptan-3-ylidene]amino]-2,4-dinitroaniline IUPAC Name: N-[(E)-[(5S)-5-methylheptan-3-ylidene]amino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(E)-[(3S)-1-ethyl-3-methyl-pentylidene]amino]amine Formula: C14H20N4O4 MolecularWeight: 308.333

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])CC

Isomeric SMILES

CC[C@H](C)C/C(=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/CC

InChI

InChI=1S/C14H20N4O4/c1-4-10(3)8-11(5-2)15-16-13-7-6-12(17(19)20)9-14(13)18(21)22/h6-7,9-10,16H,4-5,8H2,1-3H3/b15-11+/t10-/m0/s1